First-principles study of ternary graphite compounds cointercalated with alkali atoms (Li, Na, and K) and alkylamines towards alkali ion battery applications
作者： Gum-Chol Ri , Chol-Jun Yu , Jin-Song Kim , Song-Nam Hong , Un-Gi Jong
DOI: 10.1016/J.JPOWSOUR.2016.05.136
关键词: Bond length 、 Alkali metal 、 Atom 、 Graphite 、 Ionic radius 、 Valence electron 、 Crystallography 、 Inorganic chemistry 、 Chemistry 、 Molecule 、 Graphene
摘要: … First-principles calculations were carried out to investigate the structural, energetic, and electronic properties of ternary graphite … diffuses more smoothly in graphite, being similar to AM-…
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